tert-butyl (2E)-2-[5-[3-(ethoxycarbonylamino)propyl]-2,3-dihydrochromen-4-ylidene]ethanoate

Systemtic Name: tert-butyl (2E)-2-[5-[3-(ethoxycarbonylamino)propyl]-2,3-dihydrochromen-4-ylidene]ethanoate Openeye Name: tert-butyl (2E)-2-[5-[3-(ethoxycarbonylamino)propyl]chroman-4-ylidene]acetate CAS Name: (2E)-2-[5-[3-(ethoxycarbonylamino)propyl]-3,4-dihydro-2H-1-benzopyran-4-ylidene]acetic acid tert-butyl ester IUPAC Name: tert-butyl (2E)-2-[5-[3-(ethoxycarbonylamino)propyl]-2,3-dihydrochromen-4-ylidene]acetate Traditional Name: (2E)-2-[5-[3-(carbethoxyamino)propyl]chroman-4-ylidene]acetic acid tert-butyl ester Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCCCC1=C2C(=CC(=O)OC(C)(C)C)CCOC2=CC=C1

Isomeric SMILES

CCOC(=O)NCCCC1=C2/C(=C/C(=O)OC(C)(C)C)/CCOC2=CC=C1

InChI

InChI=1S/C21H29NO5/c1-5-25-20(24)22-12-7-9-15-8-6-10-17-19(15)16(11-13-26-17)14-18(23)27-21(2,3)4/h6,8,10,14H,5,7,9,11-13H2,1-4H3,(H,22,24)/b16-14+